3-[[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]amino]propanenitrile

Systemtic Name: 3-[[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]amino]propanenitrile Openeye Name: 3-[4-(1,3-dimethylimidazol-1-ium-2-yl)azoanilino]propanenitrile CAS Name: 3-[4-[(1,3-dimethyl-2-imidazol-1-iumyl)azo]anilino]propanenitrile IUPAC Name: 3-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]anilino]propanenitrile Traditional Name: 3-[4-(1,3-dimethylimidazol-1-ium-2-yl)azoanilino]propionitrile Formula: C14H17N6+ MolecularWeight: 269.32498

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)NCCC#N)C

Isomeric SMILES

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)NCCC#N)C

InChI

InChI=1S/C14H16N6/c1-19-10-11-20(2)14(19)18-17-13-6-4-12(5-7-13)16-9-3-8-15/h4-7,10-11H,3,9H2,1-2H3/p+1